Geometry & MOs

Info

ID:	320369
PubChem CID:	126659904
Reduced:	SN2O4C20H20 (1)
Stoich.:	AB2C4D20E20 (1)
Weight, g/mol:	427.30212
ΔH_f, kcal/mol:	-85.07
Dipole, Da:	3.38
IP(EA), eV:	-8.73(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[6-(ethyliminomethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]butyl]-N-[2-[[(2Z,4E)-hepta-2,4-dien-4-yl]amino]ethyl]thiohydroxylamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC=C(O2)CN(C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N

DOS

IR

Vibrations